Home Other Building Blocks Oxan-3-ylmethanol

Oxan-3-ylmethanol

CAS No.:
14774-36-8
Catalog Number:
AG001F5L
Molecular Formula:
C6H12O2
Molecular Weight:
116.1583
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$188
- +
5g
97%
In Stock USA
United States
$563
- +
10g
97%
In Stock USA
United States
$1063
- +
Product Description
Catalog Number:
AG001F5L
Chemical Name:
Oxan-3-ylmethanol
CAS Number:
14774-36-8
Molecular Formula:
C6H12O2
Molecular Weight:
116.1583
MDL Number:
MFCD08235011
IUPAC Name:
oxan-3-ylmethanol
InChI:
InChI=1S/C6H12O2/c7-4-6-2-1-3-8-5-6/h6-7H,1-5H2
InChI Key:
VFTQJKSRDCKVQA-UHFFFAOYSA-N
SMILES:
OCC1CCCOC1
EC Number:
238-841-2
Properties
Complexity:
63.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.084g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
116.16g/mol
Monoisotopic Mass:
116.084g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Literature
Title Journal
Pathways and populations: stereoelectronic insights into the exocyclic torsion of 5-(hydroxymethyl)tetrahydropyran. Journal of the American Chemical Society 20080521
Properties